⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14625402 | 0.87 | — | — | |
| SCHEMBL24158206 | 0.84 | PAOX (0.52) | — | |
| SCHEMBL19957983 | 0.84 | PAOX (0.52) | — | |
| SCHEMBL27005545 | 0.84 | PAOX (0.52) | — | |
| SCHEMBL13707457 | 0.82 | — | — | |
| SCHEMBL7790036 | 0.80 | — | — | |
| SCHEMBL22525264 | 0.80 | — | — | |
| SCHEMBL20696934 | 0.76 | CHRNA1 (0.35) | — | |
| SCHEMBL22247170 | 0.76 | — | — | |
| SCHEMBL7796308 | 0.76 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024097972-A2 | COMPOUNDS AND METHODS FOR TREATING CANCERS | CEDARS-SINAI MEDICAL CENTER (US) | 2024-05-10 | — | — | WO | disclosed |
| EP-4019508-A1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY | F. Hoffmann-La Roche AG (CH) | 2022-06-29 | — | — | EP | disclosed |
| EP-3521288-A1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY | F. Hoffmann-La Roche AG (CH) | 2019-08-07 | — | — | EP | disclosed |
| EP-3002284-B1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY | HOFFMANN LA ROCHE (CH) | 2019-05-22 | — | — | EP | disclosed |
| EP-1773786-B1 | FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2017-04-26 | — | — | EP | disclosed |
| US-20160369247-A1 | SUBSTRATE-MIMETIC AKT INHIBITOR | UNIVERSITY OF SOUTH FLORIDA (US) | 2016-12-22 | — | — | US | disclosed |
| EP-2174979-B1 | Resin composition and resin molded product | SONY CORP (JP) | 2010-11-17 | — | — | EP | disclosed |
| EP-2174979-A1 | Resin composition and resin molded product | Sony Corporation (JP) | 2010-04-14 | — | — | EP | disclosed |